[3-[4-(2-acetamidopropanoyloxy)-2,6-dimethyl-pyridin-3-yl]-3-methyl-butanoyl]boron

Systemtic Name: [3-[4-(2-acetamidopropanoyloxy)-2,6-dimethyl-pyridin-3-yl]-3-methyl-butanoyl]boron Openeye Name: [3-[4-(2-acetamidopropanoyloxy)-2,6-dimethyl-3-pyridyl]-3-methyl-butanoyl]boron CAS Name: [3-[4-(2-acetamido-1-oxopropoxy)-2,6-dimethyl-3-pyridinyl]-3-methyl-1-oxobutyl]boron IUPAC Name: [3-[4-(2-acetamidopropanoyloxy)-2,6-dimethylpyridin-3-yl]-3-methylbutanoyl]boron Traditional Name: [3-[4-(2-acetamidopropanoyloxy)-2,6-dimethyl-3-pyridyl]-3-methyl-butanoyl]boron Formula: C17H23BN2O4 MolecularWeight: 330.18652

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)CC(C)(C)C1=C(N=C(C=C1OC(=O)C(C)NC(=O)C)C)C

Isomeric SMILES

[B]C(=O)CC(C)(C)C1=C(N=C(C=C1OC(=O)C(C)NC(=O)C)C)C

InChI

InChI=1S/C17H23BN2O4/c1-9-7-13(24-16(23)11(3)20-12(4)21)15(10(2)19-9)17(5,6)8-14(18)22/h7,11H,8H2,1-6H3,(H,20,21)